SCHEMBL24837402

SCHEMBL24837402

CC(C)c1ccc(CS(C)(=N)=O)cn1

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 2/20 0.38
ESR2 Q92731 2/20 0.38
CHRNA7 P36544 1/20 0.36
NR1H2 P55055 1/20 0.36
NR1H3 Q13133 1/20 0.36
PANK3 Q9H999 2/20 0.35
PRMT5 O14744 1/20 0.32
WDR77 Q9BQA1 1/20 0.32
APLNR P35414 3/20 0.32
CCNT1 O60563 3/20 0.30
CDK9 P50750 3/20 0.30
CCNK O75909 2/20 0.30
CDK2 P24941 2/20 0.30
CDK1 P06493 1/20 0.30
CCNE1 P24864 1/20 0.30
CDK12 Q9NYV4 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL23114318 0.86 CHRNA7 (0.40) ESR1ESR2CHRNA7NR1H2NR1H3
SCHEMBL24837386 0.84 ESR1 (0.36) ESR1ESR2CHRNA7NR1H2NR1H3
SCHEMBL25825557 0.81 PANK3 (0.38) ESR1ESR2CHRNA7NR1H2NR1H3
SCHEMBL14552838 0.77 TSHR (0.41) NR1H2NR1H3CCNT1CDK9CCNK
SCHEMBL2442810 0.76 ALDH1A1 (0.46)
SCHEMBL21267702 0.75 KMT2A (0.45) CHRNA7NR1H2NR1H3
SCHEMBL20994112 0.75 ESR1 (0.39) ESR1ESR2CHRNA7NR1H2NR1H3
SCHEMBL18291549 0.74 GRIA2 (0.38) ESR1ESR2CHRNA7NR1H2NR1H3
SCHEMBL24500280 0.74 CHRNA7 (0.44) CHRNA7APLNRCDK2CDK1
SCHEMBL5513086 0.72 KDM4E (0.43) ESR1ESR2PANK3PRMT5WDR77

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11780849-B2 Imino sulfanone inhibitors of ENPP1 VOLASTRA THERAPEUTICS, INC. (US) 2023-10-10 US disclosed
US-11780849-B2 Imino sulfanone inhibitors of ENPP1 VOLASTRA THERAPEUTICS, INC. (US) 2023-10-10 US disclosed
US-20230002406-A1 IMINO SULFANONE INHIBITORS OF ENPP1 VOLASTRA THERAPEUTICS, INC. (US) 2023-01-05 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-11780849-B2 Imino sulfanone inhibitors of ENPP1 ENPP1, ENPP3, SMPD1 ESR1 3303/4885ESR2 1810/4885CHRNA7 3754/4885
US-20230002406-A1 IMINO SULFANONE INHIBITORS OF ENPP1 ENPP1, ENPP3, SMPD1 ESR1 3303/4885ESR2 1810/4885CHRNA7 3754/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.